Dichocerazine B
AlkaPlorer ID: AK110551
Synonym: None
IUPAC Name: [(3S,5aR,6R,9aR,10aS)-9a-hydroxy-3-(hydroxymethyl)-2-methyl-3,10a-bis(methylsulfanyl)-1,4,7-trioxo-6,10-dihydro-5aH-pyrazino[1,2-a]indol-6-yl] acetate
Structure
SMILES: CS[C@@]1(CO)C(=O)N2[C@@H]3[C@@H](OC(C)=O)C(=O)C=C[C@]3(O)C[C@]2(SC)C(=O)N1C
InChI: InChI=1S/C17H22N2O7S2/c1-9(21)26-11-10(22)5-6-15(25)7-16(27-3)13(23)18(2)17(8-20,28-4)14(24)19(16)12(11)15/h5-6,11-12,20,25H,7-8H2,1-4H3/t11-,12+,15-,16-,17-/m0/s1
InChIKey: UDENPRNEBPZXPX-GVDRCSPZSA-N
Reference
Diverse Secondary Metabolites from the Marine-Derived Fungus Dichotomomyces cejpii F31-1
PubChem CID: 139590537
LOTUS: LTS0264731
{NPAtlas: NPA023253
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Dichotomomyces | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 430.5040000000002
TPSA？: 124.45
MolLogP？: -1.0280999999999985
Number of H-Donors: 2
Number of H-Acceptors: 9
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|